data_nef_c30212_5u9r save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 30211 BMRB 30213 BMRB 30214 BMRB 30215 BMRB 30216 BMRB 30217 BMRB 30218 BMRB 30219 PDB 5U9R stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 23 ASN C 1 24 NH2 N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 VAL middle . . 3 A 3 VAL middle . . 4 A 4 ASP middle . . 5 A 5 ILE middle . . 6 A 6 LEU middle . . 7 A 7 LYS middle . . 8 A 8 GLY middle . false 9 A 9 ALA middle . . 10 A 10 ALA middle . . 11 A 11 LYS middle . . 12 A 12 ASP middle . . 13 A 13 ILE middle . . 14 A 14 ALA middle . . 15 A 15 GLY middle . false 16 A 16 HIS middle . . 17 A 17 LEU middle . . 18 A 18 ALA middle . . 19 A 19 SER middle . . 20 A 20 LYS middle . . 21 A 21 VAL middle . . 22 A 22 MET middle . . 23 A 23 ASN middle -OXT . 24 A 24 NH2 end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAy H 1 4.110 . A 1 GLY HAx H 1 3.957 . A 1 GLY CA C 13 43.496 . A 2 VAL H H 1 8.145 . A 2 VAL HA H 1 3.863 . A 2 VAL HB H 1 2.112 . A 2 VAL HGx% H 1 1.115 . A 2 VAL HGy% H 1 1.034 . A 2 VAL CA C 13 66.340 . A 2 VAL CB C 13 31.383 . A 2 VAL CGy C 13 21.157 . A 2 VAL CGx C 13 20.054 . A 3 VAL H H 1 8.141 . A 3 VAL HA H 1 3.791 . A 3 VAL HB H 1 2.110 . A 3 VAL HGx% H 1 1.078 . A 3 VAL HGy% H 1 0.996 . A 3 VAL CA C 13 66.067 . A 3 VAL CB C 13 32.048 . A 3 VAL CGy C 13 21.793 . A 3 VAL CGx C 13 20.655 . A 3 VAL N N 15 121.682 . A 4 ASP H H 1 7.426 . A 4 ASP HA H 1 4.391 . A 4 ASP HBy H 1 2.845 . A 4 ASP HBx H 1 2.761 . A 4 ASP CA C 13 57.327 . A 4 ASP CB C 13 41.052 . A 4 ASP N N 15 117.387 . A 5 ILE H H 1 7.614 . A 5 ILE HA H 1 3.867 . A 5 ILE HB H 1 2.171 . A 5 ILE HD1% H 1 0.910 . A 5 ILE HG1y H 1 1.732 . A 5 ILE HG1x H 1 1.248 . A 5 ILE HG2% H 1 0.976 . A 5 ILE CA C 13 64.396 . A 5 ILE CB C 13 37.862 . A 5 ILE CD1 C 13 12.004 . A 5 ILE CG1 C 13 28.135 . A 5 ILE CG2 C 13 16.331 . A 5 ILE N N 15 120.551 . A 6 LEU H H 1 8.104 . A 6 LEU HA H 1 4.160 . A 6 LEU HBy H 1 1.946 . A 6 LEU HBx H 1 1.592 . A 6 LEU HDx% H 1 0.923 . A 6 LEU HDy% H 1 0.890 . A 6 LEU HG H 1 1.888 . A 6 LEU CA C 13 58.080 . A 6 LEU CB C 13 41.532 . A 6 LEU CDy C 13 22.608 . A 6 LEU CDx C 13 21.741 . A 6 LEU CG C 13 26.719 . A 6 LEU N N 15 120.402 . A 7 LYS H H 1 8.437 . A 7 LYS HA H 1 4.085 . A 7 LYS HBy H 1 1.988 . A 7 LYS HBx H 1 1.928 . A 7 LYS HDy H 1 1.758 . A 7 LYS HEx H 1 2.968 . A 7 LYS HEy H 1 3.040 . A 7 LYS HGy H 1 1.767 . A 7 LYS HGx H 1 1.478 . A 7 LYS CA C 13 59.621 . A 7 LYS CB C 13 32.662 . A 7 LYS CD C 13 29.357 . A 7 LYS CE C 13 42.126 . A 7 LYS CG C 13 25.517 . A 7 LYS N N 15 117.855 . A 8 GLY H H 1 7.998 . A 8 GLY HAy H 1 3.945 . A 8 GLY HAx H 1 3.868 . A 8 GLY CA C 13 46.819 . A 8 GLY N N 15 106.820 . A 9 ALA H H 1 8.355 . A 9 ALA HA H 1 4.336 . A 9 ALA HB% H 1 1.568 . A 9 ALA CA C 13 54.808 . A 9 ALA CB C 13 17.874 . A 9 ALA N N 15 125.131 . A 10 ALA H H 1 8.212 . A 10 ALA HA H 1 4.131 . A 10 ALA HB% H 1 1.568 . A 10 ALA CA C 13 55.714 . A 10 ALA CB C 13 17.629 . A 10 ALA N N 15 119.948 . A 11 LYS H H 1 7.898 . A 11 LYS HA H 1 4.129 . A 11 LYS HBy H 1 2.022 . A 11 LYS HBx H 1 1.922 . A 11 LYS HDy H 1 1.682 . A 11 LYS HDx H 1 1.539 . A 11 LYS HEy H 1 3.053 . A 11 LYS HEx H 1 2.973 . A 11 LYS HGy H 1 1.565 . A 11 LYS HGx H 1 1.517 . A 11 LYS CA C 13 59.192 . A 11 LYS CB C 13 32.170 . A 11 LYS CD C 13 24.832 . A 11 LYS CE C 13 42.173 . A 11 LYS CG C 13 24.607 . A 11 LYS N N 15 117.053 . A 12 ASP H H 1 8.047 . A 12 ASP HA H 1 4.631 . A 12 ASP HBy H 1 2.936 . A 12 ASP HBx H 1 2.843 . A 12 ASP CA C 13 56.936 . A 12 ASP CB C 13 40.829 . A 12 ASP N N 15 121.253 . A 13 ILE H H 1 8.505 . A 13 ILE HA H 1 3.829 . A 13 ILE HB H 1 1.990 . A 13 ILE HD1% H 1 0.898 . A 13 ILE HG1y H 1 1.838 . A 13 ILE HG1x H 1 1.162 . A 13 ILE HG2% H 1 0.999 . A 13 ILE CA C 13 65.415 . A 13 ILE CB C 13 39.303 . A 13 ILE CD1 C 13 12.320 . A 13 ILE CG1 C 13 28.911 . A 13 ILE CG2 C 13 16.449 . A 13 ILE N N 15 122.742 . A 14 ALA H H 1 8.416 . A 14 ALA HA H 1 4.130 . A 14 ALA HB% H 1 1.569 . A 14 ALA CA C 13 55.220 . A 14 ALA CB C 13 17.643 . A 14 ALA N N 15 122.066 . A 15 GLY H H 1 8.278 . A 15 GLY HAy H 1 3.978 . A 15 GLY HAx H 1 3.888 . A 15 GLY CA C 13 46.838 . A 15 GLY N N 15 117.600 . A 16 HIS H H 1 8.151 . A 16 HIS HA H 1 4.425 . A 16 HIS HBx H 1 3.363 . A 16 HIS HD2 H 1 7.094 . A 16 HIS CA C 13 59.856 . A 16 HIS CB C 13 29.071 . A 16 HIS N N 15 118.050 . A 17 LEU H H 1 8.634 . A 17 LEU HA H 1 4.138 . A 17 LEU HBy H 1 1.921 . A 17 LEU HBx H 1 1.668 . A 17 LEU HDx% H 1 0.944 . A 17 LEU HDy% H 1 0.922 . A 17 LEU HG H 1 1.875 . A 17 LEU CA C 13 58.292 . A 17 LEU CB C 13 41.679 . A 17 LEU CDx C 13 24.168 . A 17 LEU CDy C 13 24.587 . A 17 LEU CG C 13 26.848 . A 17 LEU N N 15 121.458 . A 18 ALA H H 1 8.544 . A 18 ALA HA H 1 4.088 . A 18 ALA HB% H 1 1.544 . A 18 ALA CA C 13 55.306 . A 18 ALA CB C 13 17.531 . A 18 ALA N N 15 120.556 . A 19 SER H H 1 7.846 . A 19 SER HA H 1 4.213 . A 19 SER HBx H 1 4.059 . A 19 SER CA C 13 61.414 . A 19 SER CB C 13 63.114 . A 19 SER N N 15 111.184 . A 20 LYS H H 1 8.281 . A 20 LYS HA H 1 4.380 . A 20 LYS HBy H 1 2.725 . A 20 LYS HBx H 1 2.623 . A 20 LYS HDx H 1 2.152 . A 20 LYS HEy H 1 2.978 . A 20 LYS HGy H 1 1.572 . A 20 LYS HGx H 1 1.499 . A 20 LYS CA C 13 57.028 . A 20 LYS CB C 13 32.236 . A 20 LYS CD C 13 32.433 . A 20 LYS CE C 13 42.093 . A 20 LYS CG C 13 24.444 . A 20 LYS N N 15 117.628 . A 21 VAL H H 1 8.082 . A 21 VAL HA H 1 3.872 . A 21 VAL HB H 1 2.233 . A 21 VAL HGx% H 1 1.075 . A 21 VAL HGy% H 1 0.991 . A 21 VAL CA C 13 65.279 . A 21 VAL CB C 13 32.242 . A 21 VAL CGy C 13 21.132 . A 21 VAL CGx C 13 20.655 . A 21 VAL N N 15 118.551 . A 22 MET H H 1 7.822 . A 22 MET HA H 1 4.233 . A 22 MET HBy H 1 1.709 . A 22 MET HBx H 1 1.505 . A 22 MET HGx H 1 2.035 . A 22 MET CA C 13 58.352 . A 22 MET CB C 13 28.748 . A 22 MET CG C 13 32.011 . A 22 MET N N 15 121.613 . A 23 ASN H H 1 7.844 . A 23 ASN HA H 1 4.371 . A 23 ASN HBy H 1 2.903 . A 23 ASN HBx H 1 2.834 . A 23 ASN HD2y H 1 7.631 . A 23 ASN HD2x H 1 6.697 . A 23 ASN CA C 13 57.125 . A 23 ASN CB C 13 39.518 . A 23 ASN N N 15 116.941 . A 23 ASN ND2 N 15 111.833 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 VAL HB A 2 VAL HA 1.0 1.8 5.5 2 2 A 2 VAL HA A 2 VAL HGx% 1.0 1.8 5.5 3 3 A 2 VAL HA A 2 VAL HGx% 1.0 1.8 5.5 4 4 A 2 VAL HB A 2 VAL HGx% 1.0 1.8 5.5 5 5 A 2 VAL HB A 2 VAL HGx% 1.0 1.8 5.5 6 6 A 2 VAL HA A 2 VAL HGy% 1.0 1.8 5.5 7 7 A 2 VAL HA A 2 VAL HGy% 1.0 1.8 5.5 8 8 A 2 VAL HB A 2 VAL HGy% 1.0 1.8 5.5 9 9 A 2 VAL HB A 2 VAL HGy% 1.0 1.8 5.5 10 10 A 2 VAL HA A 2 VAL H 1.0 1.8 5.5 11 11 A 2 VAL HGx% A 2 VAL H 1.0 1.8 5.5 12 12 A 2 VAL HGy% A 2 VAL H 1.0 1.8 5.5 13 13 A 3 VAL HA A 3 VAL HB 1.0 1.8 3.4 14 14 A 3 VAL HA A 3 VAL HB 1.0 1.8 3.4 15 15 A 3 VAL HA A 3 VAL HGx% 1.0 1.8 5.5 16 16 A 3 VAL HA A 3 VAL HGx% 1.0 1.8 5.5 17 17 A 3 VAL HB A 3 VAL HGx% 1.0 1.8 5.5 18 18 A 3 VAL HA A 3 VAL HGy% 1.0 1.8 5.5 19 19 A 3 VAL HA A 3 VAL HGy% 1.0 1.8 5.5 20 20 A 3 VAL HB A 3 VAL HGy% 1.0 1.8 3.4 21 21 A 3 VAL HGx% A 3 VAL HGy% 1.0 1.8 3.4 22 22 A 3 VAL HGx% A 3 VAL HGy% 1.0 1.8 3.4 23 23 A 3 VAL HA A 3 VAL H 1.0 1.8 2.8 24 24 A 3 VAL HA A 3 VAL H 1.0 1.8 2.8 25 25 A 3 VAL HB A 3 VAL H 1.0 1.8 2.8 26 26 A 3 VAL HB A 3 VAL H 1.0 1.8 2.8 27 27 A 3 VAL HGx% A 3 VAL H 1.0 1.8 5.5 28 28 A 3 VAL HGx% A 3 VAL H 1.0 1.8 5.5 29 29 A 3 VAL HGy% A 3 VAL H 1.0 1.8 5.5 30 30 A 3 VAL HGy% A 3 VAL H 1.0 1.8 5.5 31 31 A 4 ASP HA A 4 ASP HBx 1.0 1.8 5.5 32 32 A 4 ASP HA A 4 ASP HBx 1.0 1.8 5.5 33 33 A 4 ASP HA A 4 ASP HBy 1.0 1.8 3.4 34 34 A 4 ASP HA A 4 ASP HBy 1.0 1.8 5.5 35 35 A 4 ASP HBx A 4 ASP HBy 1.0 1.8 2.8 36 36 A 4 ASP HBx A 4 ASP HBy 1.0 1.8 2.8 37 37 A 4 ASP HA A 4 ASP H 1.0 1.8 3.4 38 38 A 4 ASP HA A 4 ASP H 1.0 1.8 5.5 39 39 A 4 ASP HBx A 4 ASP H 1.0 1.8 3.4 40 40 A 4 ASP HBx A 4 ASP H 1.0 1.8 3.4 41 41 A 4 ASP HBy A 4 ASP H 1.0 1.8 5.5 42 42 A 4 ASP HBy A 4 ASP H 1.0 1.8 5.5 43 43 A 5 ILE HB A 5 ILE HA 1.0 1.8 3.4 44 44 A 5 ILE HB A 5 ILE HA 1.0 1.8 3.4 45 45 A 5 ILE HA A 5 ILE HD1% 1.0 1.8 5.5 46 46 A 5 ILE HA A 5 ILE HD1% 1.0 1.8 5.5 47 47 A 5 ILE HB A 5 ILE HD1% 1.0 1.8 5.5 48 48 A 5 ILE HB A 5 ILE HD1% 1.0 1.8 5.5 49 49 A 5 ILE HA A 5 ILE HG1x 1.0 1.8 5.5 50 50 A 5 ILE HA A 5 ILE HG1x 1.0 1.8 3.4 51 51 A 5 ILE HB A 5 ILE HG1x 1.0 1.8 5.5 52 52 A 5 ILE HB A 5 ILE HG1x 1.0 1.8 5.5 53 53 A 5 ILE HD1% A 5 ILE HG1x 1.0 1.8 5.5 54 54 A 5 ILE HD1% A 5 ILE HG1x 1.0 1.8 5.5 55 55 A 5 ILE HA A 5 ILE HG1y 1.0 1.8 3.4 56 56 A 5 ILE HA A 5 ILE HG1y 1.0 1.8 3.4 57 57 A 5 ILE HB A 5 ILE HG1y 1.0 1.8 5.5 58 58 A 5 ILE HB A 5 ILE HG1y 1.0 1.8 5.5 59 59 A 5 ILE HD1% A 5 ILE HG1y 1.0 1.8 5.5 60 60 A 5 ILE HD1% A 5 ILE HG1y 1.0 1.8 5.5 61 61 A 5 ILE HG1x A 5 ILE HG1y 1.0 1.8 2.8 62 62 A 5 ILE HG1x A 5 ILE HG1y 1.0 1.8 2.8 63 63 A 5 ILE HA A 5 ILE HG2% 1.0 1.8 3.4 64 64 A 5 ILE HB A 5 ILE HG2% 1.0 1.8 5.5 65 65 A 5 ILE HB A 5 ILE HG2% 1.0 1.8 3.4 66 66 A 5 ILE HG1x A 5 ILE HG2% 1.0 1.8 5.5 67 67 A 5 ILE HG1x A 5 ILE HG2% 1.0 1.8 5.5 68 68 A 5 ILE HG1y A 5 ILE HG2% 1.0 1.8 5.5 69 69 A 5 ILE HG1y A 5 ILE HG2% 1.0 1.8 5.5 70 70 A 5 ILE HA A 5 ILE H 1.0 1.8 2.8 71 71 A 5 ILE HA A 5 ILE H 1.0 1.8 2.8 72 72 A 5 ILE HB A 5 ILE H 1.0 1.8 2.8 73 73 A 5 ILE HB A 5 ILE H 1.0 1.8 3.4 74 74 A 5 ILE HD1% A 5 ILE H 1.0 1.8 5.5 75 75 A 5 ILE HD1% A 5 ILE H 1.0 1.8 5.5 76 76 A 5 ILE HG1x A 5 ILE H 1.0 1.8 3.4 77 77 A 5 ILE HG1x A 5 ILE H 1.0 1.8 3.4 78 78 A 5 ILE HG1y A 5 ILE H 1.0 1.8 5.5 79 79 A 5 ILE HG1y A 5 ILE H 1.0 1.8 5.5 80 80 A 5 ILE HG2% A 5 ILE H 1.0 1.8 5.5 81 81 A 5 ILE HG2% A 5 ILE H 1.0 1.8 5.5 82 82 A 6 LEU HBy A 6 LEU HA 1.0 1.8 3.4 83 83 A 6 LEU HBy A 6 LEU HBx 1.0 1.8 2.8 84 84 A 6 LEU HBy A 6 LEU HBx 1.0 1.8 2.8 85 85 A 6 LEU HBx A 6 LEU HDx% 1.0 1.8 5.5 86 86 A 6 LEU HBy A 6 LEU HDx% 1.0 1.8 5.5 87 87 A 6 LEU HBy A 6 LEU HDx% 1.0 1.8 5.5 88 88 A 6 LEU HA A 6 LEU HDy% 1.0 1.8 5.5 89 89 A 6 LEU HA A 6 LEU HDy% 1.0 1.8 5.5 90 90 A 6 LEU HBy A 6 LEU HDy% 1.0 1.8 5.5 91 91 A 6 LEU HA A 6 LEU H 1.0 1.8 2.8 92 92 A 6 LEU HA A 6 LEU H 1.0 1.8 3.4 93 93 A 6 LEU HBx A 6 LEU H 1.0 1.8 2.8 94 94 A 6 LEU HBx A 6 LEU H 1.0 1.8 5.5 95 95 A 6 LEU HBy A 6 LEU H 1.0 1.8 3.4 96 96 A 6 LEU HBy A 6 LEU H 1.0 1.8 5.5 97 97 A 6 LEU HDx% A 6 LEU H 1.0 1.8 5.5 98 98 A 6 LEU HDx% A 6 LEU H 1.0 1.8 5.5 99 99 A 6 LEU HDy% A 6 LEU H 1.0 1.8 5.5 100 100 A 6 LEU HDy% A 6 LEU H 1.0 1.8 5.5 101 101 A 6 LEU H A 6 LEU HG 1.0 1.8 3.4 102 102 A 6 LEU H A 6 LEU HG 1.0 1.8 2.8 103 103 A 7 LYS HA A 7 LYS HBx 1.0 1.8 3.4 104 104 A 7 LYS HA A 7 LYS HBy 1.0 1.8 3.4 105 105 A 7 LYS HA A 7 LYS HDx 1.0 1.8 5.5 106 106 A 7 LYS HA A 7 LYS HDx 1.0 1.8 5.5 107 107 A 7 LYS HDx A 7 LYS HEy 1.0 1.8 5.5 108 108 A 7 LYS HDx A 7 LYS HEy 1.0 1.8 5.5 109 109 A 7 LYS HDx A 7 LYS HEx 1.0 1.8 3.4 110 110 A 7 LYS HDx A 7 LYS HEx 1.0 1.8 5.5 111 111 A 7 LYS HA A 7 LYS HGy 1.0 1.8 3.4 112 112 A 7 LYS HA A 7 LYS HGy 1.0 1.8 5.5 113 113 A 7 LYS HBy A 7 LYS HGy 1.0 1.8 5.5 114 114 A 7 LYS HBy A 7 LYS HGy 1.0 1.8 5.5 115 115 A 7 LYS HDx A 7 LYS HGy 1.0 1.8 2.8 116 116 A 7 LYS HDx A 7 LYS HGy 1.0 1.8 2.8 117 117 A 7 LYS HEx A 7 LYS HGy 1.0 1.8 5.5 118 118 A 7 LYS HEx A 7 LYS HGy 1.0 1.8 5.5 119 119 A 7 LYS HA A 7 LYS H 1.0 1.8 3.4 120 120 A 7 LYS HA A 7 LYS H 1.0 1.8 3.4 121 121 A 7 LYS HBx A 7 LYS H 1.0 1.8 3.4 122 122 A 7 LYS HBx A 7 LYS H 1.0 2.4 3.4 123 123 A 7 LYS HBy A 7 LYS H 1.0 1.8 3.4 124 124 A 7 LYS HBy A 7 LYS H 1.0 2.4 3.4 125 125 A 7 LYS HDx A 7 LYS H 1.0 1.8 2.8 126 126 A 7 LYS HDx A 7 LYS H 1.0 1.8 5.5 127 127 A 7 LYS HGy A 7 LYS H 1.0 1.8 5.5 128 128 A 7 LYS HGy A 7 LYS H 1.0 1.8 5.5 129 129 A 8 GLY H A 8 GLY HAx 1.0 1.8 2.8 130 130 A 8 GLY H A 8 GLY HAx 1.0 1.8 2.8 131 131 A 8 GLY H A 8 GLY HAy 1.0 1.8 5.5 132 132 A 8 GLY H A 8 GLY HAy 1.0 1.8 5.5 133 133 A 9 ALA HA A 9 ALA HB% 1.0 1.8 3.4 134 134 A 9 ALA HA A 9 ALA HB% 1.0 1.8 5.5 135 135 A 9 ALA HA A 9 ALA H 1.0 1.8 2.8 136 136 A 9 ALA HA A 9 ALA H 1.0 1.8 2.8 137 137 A 9 ALA HB% A 9 ALA H 1.0 1.8 3.4 138 138 A 9 ALA HB% A 9 ALA H 1.0 1.8 3.4 139 139 A 10 ALA H A 10 ALA HA 1.0 1.8 2.8 140 140 A 10 ALA H A 10 ALA HA 1.0 1.8 2.8 141 141 A 10 ALA H A 10 ALA HB% 1.0 1.8 2.8 142 142 A 10 ALA H A 10 ALA HB% 1.0 1.8 3.4 143 143 A 11 LYS HBx A 11 LYS HA 1.0 1.8 2.8 144 144 A 11 LYS HBx A 11 LYS HA 1.0 1.8 2.8 145 145 A 11 LYS HA A 11 LYS HBy 1.0 1.8 3.4 146 146 A 11 LYS HA A 11 LYS HDx 1.0 1.8 5.5 147 147 A 11 LYS HBx A 11 LYS HDx 1.0 1.8 3.4 148 148 A 11 LYS HBy A 11 LYS HDx 1.0 1.8 2.8 149 149 A 11 LYS HBy A 11 LYS HDx 1.0 1.8 2.8 150 150 A 11 LYS HBx A 11 LYS HEx 1.0 1.8 5.5 151 151 A 11 LYS HDx A 11 LYS HEx 1.0 1.8 5.5 152 152 A 11 LYS HEx A 11 LYS HDy 1.0 1.8 5.5 153 153 A 11 LYS HA A 11 LYS HGx 1.0 2.4 3.4 154 154 A 11 LYS HA A 11 LYS HGx 1.0 2.4 3.4 155 155 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 3.4 156 156 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 3.4 157 157 A 11 LYS HDx A 11 LYS HGx 1.0 1.8 2.8 158 158 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 5.5 159 159 A 11 LYS HA A 11 LYS H 1.0 1.8 2.8 160 160 A 11 LYS HA A 11 LYS H 1.0 1.8 2.8 161 161 A 11 LYS HBx A 11 LYS H 1.0 2.4 3.4 162 162 A 11 LYS HBx A 11 LYS H 1.0 2.4 3.4 163 163 A 11 LYS HDx A 11 LYS H 1.0 1.8 5.5 164 164 A 11 LYS HDx A 11 LYS H 1.0 1.8 5.5 165 165 A 11 LYS HGx A 11 LYS H 1.0 1.8 2.8 166 166 A 12 ASP HBx A 12 ASP HA 1.0 1.8 5.5 167 167 A 12 ASP HBx A 12 ASP HA 1.0 1.8 3.4 168 168 A 12 ASP HA A 12 ASP HBy 1.0 1.8 5.5 169 169 A 12 ASP HA A 12 ASP HBy 1.0 1.8 5.5 170 170 A 12 ASP HA A 12 ASP H 1.0 1.8 3.4 171 171 A 12 ASP HA A 12 ASP H 1.0 1.8 3.4 172 172 A 12 ASP HBx A 12 ASP H 1.0 1.8 2.8 173 173 A 12 ASP HBx A 12 ASP H 1.0 1.8 3.4 174 174 A 12 ASP HBy A 12 ASP H 1.0 1.8 3.4 175 175 A 12 ASP HBy A 12 ASP H 1.0 1.8 5.5 176 176 A 13 ILE HA A 13 ILE HB 1.0 1.8 3.4 177 177 A 13 ILE HA A 13 ILE HB 1.0 1.8 5.5 178 178 A 13 ILE HB A 13 ILE HD1% 1.0 1.8 5.5 179 179 A 13 ILE HB A 13 ILE HD1% 1.0 1.8 5.5 180 180 A 13 ILE HA A 13 ILE HG1x 1.0 1.8 3.4 181 181 A 13 ILE HA A 13 ILE HG1x 1.0 1.8 5.5 182 182 A 13 ILE HB A 13 ILE HG1x 1.0 1.8 3.4 183 183 A 13 ILE HD1% A 13 ILE HG1x 1.0 1.8 3.4 184 184 A 13 ILE HA A 13 ILE HG1y 1.0 1.8 3.4 185 185 A 13 ILE HA A 13 ILE HG1y 1.0 1.8 3.4 186 186 A 13 ILE HB A 13 ILE HG1y 1.0 1.8 5.5 187 187 A 13 ILE HB A 13 ILE HG1y 1.0 1.8 5.5 188 188 A 13 ILE HD1% A 13 ILE HG1y 1.0 1.8 5.5 189 189 A 13 ILE HD1% A 13 ILE HG1y 1.0 1.8 3.4 190 190 A 13 ILE HG1x A 13 ILE HG1y 1.0 1.8 2.8 191 191 A 13 ILE HG1x A 13 ILE HG1y 1.0 1.8 5.5 192 192 A 13 ILE HA A 13 ILE HG2% 1.0 1.8 5.5 193 193 A 13 ILE HB A 13 ILE HG2% 1.0 1.8 5.5 194 194 A 13 ILE HB A 13 ILE HG2% 1.0 1.8 3.4 195 195 A 13 ILE HG1x A 13 ILE HG2% 1.0 1.8 5.5 196 196 A 13 ILE HG1y A 13 ILE HG2% 1.0 1.8 5.5 197 197 A 13 ILE HG1y A 13 ILE HG2% 1.0 1.8 5.5 198 198 A 13 ILE HA A 13 ILE H 1.0 1.8 2.8 199 199 A 13 ILE HA A 13 ILE H 1.0 1.8 3.4 200 200 A 13 ILE HB A 13 ILE H 1.0 1.8 2.8 201 201 A 13 ILE HB A 13 ILE H 1.0 1.8 2.8 202 202 A 13 ILE HD1% A 13 ILE H 1.0 1.8 5.5 203 203 A 13 ILE HD1% A 13 ILE H 1.0 1.8 5.5 204 204 A 13 ILE HG1x A 13 ILE H 1.0 1.8 2.8 205 205 A 13 ILE HG1x A 13 ILE H 1.0 1.8 3.4 206 206 A 13 ILE HG1y A 13 ILE H 1.0 1.8 5.5 207 207 A 13 ILE HG1y A 13 ILE H 1.0 1.8 5.5 208 208 A 13 ILE HG2% A 13 ILE H 1.0 1.8 5.5 209 209 A 13 ILE HG2% A 13 ILE H 1.0 1.8 5.5 210 210 A 14 ALA H A 14 ALA HA 1.0 1.8 2.8 211 211 A 14 ALA H A 14 ALA HA 1.0 1.8 2.8 212 212 A 14 ALA H A 14 ALA HB% 1.0 1.8 3.4 213 213 A 14 ALA H A 14 ALA HB% 1.0 1.8 3.4 214 214 A 15 GLY H A 15 GLY HAx 1.0 1.8 2.8 215 215 A 15 GLY H A 15 GLY HAx 1.0 1.8 3.4 216 216 A 15 GLY H A 15 GLY HAy 1.0 1.8 3.4 217 217 A 15 GLY H A 15 GLY HAy 1.0 1.8 5.5 218 218 A 16 HIS HBy A 16 HIS HA 1.0 1.8 3.4 219 219 A 16 HIS HBy A 16 HIS HA 1.0 1.8 2.8 220 220 A 16 HIS HA A 16 HIS HD2 1.0 1.8 5.5 221 221 A 16 HIS HA A 16 HIS HD2 1.0 1.8 5.5 222 222 A 16 HIS HBy A 16 HIS HD2 1.0 1.8 3.4 223 223 A 16 HIS HBy A 16 HIS HD2 1.0 1.8 5.5 224 224 A 16 HIS HA A 16 HIS H 1.0 1.8 3.4 225 225 A 16 HIS HA A 16 HIS H 1.0 1.8 5.5 226 226 A 16 HIS HBy A 16 HIS H 1.0 1.8 2.8 227 227 A 16 HIS HBy A 16 HIS H 1.0 1.8 3.4 228 228 A 16 HIS HD2 A 16 HIS H 1.0 1.8 5.5 229 229 A 16 HIS HD2 A 16 HIS H 1.0 1.8 5.5 230 230 A 17 LEU HA A 17 LEU HBx 1.0 1.8 2.8 231 231 A 17 LEU HA A 17 LEU HBy 1.0 1.8 3.4 232 232 A 17 LEU HA A 17 LEU HDx% 1.0 1.8 5.5 233 233 A 17 LEU HA A 17 LEU HDx% 1.0 1.8 5.5 234 234 A 17 LEU HBx A 17 LEU HDx% 1.0 1.8 5.5 235 235 A 17 LEU HBy A 17 LEU HDx% 1.0 1.8 5.5 236 236 A 17 LEU HBy A 17 LEU HDx% 1.0 1.8 5.5 237 237 A 17 LEU HA A 17 LEU HDy% 1.0 1.8 5.5 238 238 A 17 LEU HBx A 17 LEU HDy% 1.0 1.8 5.5 239 239 A 17 LEU HBy A 17 LEU HDy% 1.0 1.8 5.5 240 240 A 17 LEU HA A 17 LEU HG 1.0 1.8 5.5 241 241 A 17 LEU HDx% A 17 LEU HG 1.0 1.8 5.5 242 242 A 17 LEU HDy% A 17 LEU HG 1.0 1.8 3.4 243 243 A 17 LEU HDy% A 17 LEU HG 1.0 1.8 3.4 244 244 A 17 LEU HA A 17 LEU H 1.0 1.8 2.8 245 245 A 17 LEU HA A 17 LEU H 1.0 1.8 2.8 246 246 A 17 LEU HBx A 17 LEU H 1.0 1.8 2.8 247 247 A 17 LEU HBx A 17 LEU H 1.0 1.8 3.4 248 248 A 17 LEU HBy A 17 LEU H 1.0 1.8 3.4 249 249 A 17 LEU HBy A 17 LEU H 1.0 1.8 5.5 250 250 A 17 LEU HDx% A 17 LEU H 1.0 1.8 5.5 251 251 A 17 LEU HDx% A 17 LEU H 1.0 1.8 5.5 252 252 A 17 LEU HDy% A 17 LEU H 1.0 1.8 5.5 253 253 A 17 LEU HG A 17 LEU H 1.0 1.8 5.5 254 254 A 18 ALA HA A 18 ALA HB% 1.0 1.8 3.4 255 255 A 18 ALA HA A 18 ALA H 1.0 1.8 2.8 256 256 A 18 ALA HA A 18 ALA H 1.0 1.8 3.4 257 257 A 18 ALA HB% A 18 ALA H 1.0 1.8 3.4 258 258 A 18 ALA HB% A 18 ALA H 1.0 1.8 3.4 259 259 A 19 SER HBy A 19 SER HA 1.0 1.8 3.4 260 260 A 19 SER HBy A 19 SER HA 1.0 1.8 2.8 261 261 A 19 SER HA A 19 SER H 1.0 1.8 2.8 262 262 A 19 SER HA A 19 SER H 1.0 1.8 2.8 263 263 A 19 SER HBy A 19 SER H 1.0 1.8 2.8 264 264 A 19 SER HBy A 19 SER H 1.0 1.8 3.4 265 265 A 20 LYS HA A 20 LYS HBy 1.0 1.8 5.5 266 266 A 20 LYS HA A 20 LYS HBy 1.0 1.8 5.5 267 267 A 20 LYS HBy A 20 LYS HBx 1.0 1.8 2.8 268 268 A 20 LYS HBy A 20 LYS HBx 1.0 1.8 2.8 269 269 A 20 LYS HA A 20 LYS HDy 1.0 1.8 5.5 270 270 A 20 LYS HA A 20 LYS HDy 1.0 1.8 3.4 271 271 A 20 LYS HBx A 20 LYS HDy 1.0 1.8 5.5 272 272 A 20 LYS HBx A 20 LYS HDy 1.0 1.8 3.4 273 273 A 20 LYS HBy A 20 LYS HDy 1.0 1.8 5.5 274 274 A 20 LYS HBy A 20 LYS HDy 1.0 1.8 3.4 275 275 A 20 LYS HA A 20 LYS H 1.0 1.8 3.4 276 276 A 20 LYS HA A 20 LYS H 1.0 1.8 3.4 277 277 A 20 LYS HBx A 20 LYS H 1.0 1.8 5.5 278 278 A 20 LYS HBx A 20 LYS H 1.0 1.8 5.5 279 279 A 20 LYS HBy A 20 LYS H 1.0 1.8 5.5 280 280 A 20 LYS HBy A 20 LYS H 1.0 1.8 5.5 281 281 A 20 LYS HDy A 20 LYS H 1.0 1.8 2.8 282 282 A 20 LYS HDy A 20 LYS H 1.0 1.8 3.4 283 283 A 20 LYS H A 20 LYS HGx 1.0 1.8 3.4 284 284 A 20 LYS H A 20 LYS HGx 1.0 1.8 2.8 285 285 A 21 VAL HB A 21 VAL HA 1.0 1.8 3.4 286 286 A 21 VAL HB A 21 VAL HA 1.0 1.8 3.4 287 287 A 21 VAL HA A 21 VAL HGx% 1.0 1.8 5.5 288 288 A 21 VAL HB A 21 VAL HGx% 1.0 1.8 5.5 289 289 A 21 VAL HB A 21 VAL HGx% 1.0 1.8 5.5 290 290 A 21 VAL HA A 21 VAL HGy% 1.0 1.8 5.5 291 291 A 21 VAL HB A 21 VAL HGy% 1.0 1.8 5.5 292 292 A 21 VAL HB A 21 VAL HGy% 1.0 1.8 5.5 293 293 A 21 VAL HA A 21 VAL H 1.0 1.8 2.8 294 294 A 21 VAL HA A 21 VAL H 1.0 1.8 2.8 295 295 A 21 VAL HB A 21 VAL H 1.0 1.8 3.4 296 296 A 21 VAL HB A 21 VAL H 1.0 1.8 2.8 297 297 A 21 VAL HGx% A 21 VAL H 1.0 1.8 5.5 298 298 A 21 VAL HGx% A 21 VAL H 1.0 1.8 5.5 299 299 A 21 VAL HGy% A 21 VAL H 1.0 1.8 5.5 300 300 A 21 VAL HGy% A 21 VAL H 1.0 1.8 5.5 301 301 A 22 MET HA A 22 MET HBx 1.0 1.8 5.5 302 302 A 22 MET HA A 22 MET HBx 1.0 1.8 5.5 303 303 A 22 MET HA A 22 MET HBy 1.0 1.8 5.5 304 304 A 22 MET HA A 22 MET HBy 1.0 1.8 5.5 305 305 A 22 MET HA A 22 MET HGy 1.0 1.8 3.4 306 306 A 22 MET HA A 22 MET HGy 1.0 1.8 2.8 307 307 A 22 MET HA A 22 MET H 1.0 1.8 2.8 308 308 A 22 MET HA A 22 MET H 1.0 1.8 3.4 309 309 A 22 MET HGy A 22 MET H 1.0 1.8 3.4 310 310 A 22 MET HGy A 22 MET H 1.0 1.8 2.8 311 311 A 23 ASN HBx A 23 ASN HD2y 1.0 1.8 5.5 312 311 A 23 ASN HBx A 23 ASN HD2x 1.0 1.8 5.5 313 312 A 23 ASN HBx A 23 ASN HD2y 1.0 1.8 5.5 314 312 A 23 ASN HBx A 23 ASN HD2x 1.0 1.8 5.5 315 313 A 23 ASN HBy A 23 ASN HD2y 1.0 1.8 3.4 316 313 A 23 ASN HBy A 23 ASN HD2x 1.0 1.8 3.4 317 314 A 23 ASN HBx A 23 ASN HD2x 1.0 1.8 5.5 318 315 A 23 ASN HBy A 23 ASN HD2x 1.0 1.8 5.5 319 316 A 23 ASN HBy A 23 ASN HD2x 1.0 1.8 5.5 320 317 A 23 ASN HD2x A 23 ASN HD2y 1.0 1.8 2.8 321 318 A 23 ASN HD2x A 23 ASN HD2y 1.0 1.8 2.8 322 319 A 23 ASN H A 23 ASN HA 1.0 1.8 5.5 323 320 A 23 ASN H A 23 ASN HA 1.0 1.8 5.5 324 321 A 23 ASN HBx A 23 ASN H 1.0 1.8 5.5 325 322 A 23 ASN HBx A 23 ASN H 1.0 1.8 5.5 326 323 A 23 ASN HBy A 23 ASN H 1.0 1.8 3.4 327 324 A 23 ASN HBy A 23 ASN H 1.0 1.8 3.4 328 325 A 23 ASN HD2x A 23 ASN H 1.0 1.8 5.5 329 326 A 2 VAL HA A 3 VAL H 1.0 1.8 5.5 330 327 A 3 VAL HA A 4 ASP H 1.0 1.8 5.5 331 328 A 3 VAL HA A 4 ASP H 1.0 1.8 5.5 332 329 A 3 VAL HB A 4 ASP H 1.0 1.8 5.5 333 330 A 3 VAL HB A 4 ASP H 1.0 1.8 5.5 334 331 A 3 VAL HGx% A 4 ASP H 1.0 1.8 5.5 335 332 A 3 VAL HGx% A 4 ASP H 1.0 1.8 5.5 336 333 A 3 VAL HGy% A 4 ASP H 1.0 1.8 5.5 337 334 A 3 VAL HGy% A 4 ASP H 1.0 1.8 5.5 338 335 A 3 VAL H A 4 ASP H 1.0 1.8 3.4 339 336 A 3 VAL H A 4 ASP H 1.0 1.8 2.8 340 337 A 4 ASP HA A 5 ILE H 1.0 1.8 5.5 341 338 A 4 ASP HA A 5 ILE H 1.0 1.8 5.5 342 339 A 4 ASP HBx A 5 ILE H 1.0 1.8 3.4 343 340 A 4 ASP HBx A 5 ILE H 1.0 1.8 5.5 344 341 A 4 ASP HBy A 5 ILE H 1.0 1.8 5.5 345 342 A 4 ASP HBy A 5 ILE H 1.0 1.8 5.5 346 343 A 4 ASP H A 5 ILE H 1.0 1.8 2.8 347 344 A 4 ASP H A 5 ILE H 1.0 1.8 2.8 348 345 A 5 ILE HA A 6 LEU H 1.0 1.8 3.4 349 346 A 5 ILE HB A 6 LEU H 1.0 1.8 3.4 350 347 A 5 ILE HB A 6 LEU H 1.0 1.8 2.8 351 348 A 5 ILE HG1x A 6 LEU H 1.0 1.8 5.5 352 349 A 5 ILE HG1x A 6 LEU H 1.0 1.8 5.5 353 350 A 5 ILE HG2% A 6 LEU H 1.0 1.8 5.5 354 351 A 5 ILE H A 6 LEU H 1.0 1.8 3.4 355 352 A 5 ILE H A 6 LEU H 1.0 1.8 2.8 356 353 A 6 LEU HA A 7 LYS H 1.0 1.8 5.5 357 354 A 6 LEU HBy A 7 LYS H 1.0 3.9 5.5 358 355 A 6 LEU HBy A 7 LYS H 1.0 1.8 5.5 359 356 A 6 LEU H A 7 LYS H 1.0 1.8 2.8 360 357 A 6 LEU H A 7 LYS H 1.0 1.8 3.4 361 358 A 7 LYS HA A 8 GLY H 1.0 1.8 5.5 362 359 A 7 LYS HA A 8 GLY H 1.0 1.8 5.5 363 360 A 7 LYS HBx A 8 GLY H 1.0 1.8 5.5 364 361 A 7 LYS HBx A 8 GLY H 1.0 1.8 5.5 365 362 A 7 LYS HBy A 8 GLY H 1.0 3.9 5.5 366 363 A 7 LYS HBy A 8 GLY H 1.0 1.8 5.5 367 364 A 7 LYS H A 8 GLY H 1.0 1.8 3.4 368 365 A 7 LYS H A 8 GLY H 1.0 1.8 2.8 369 366 A 8 GLY HAx A 9 ALA H 1.0 1.8 3.4 370 367 A 8 GLY HAx A 9 ALA H 1.0 1.8 3.4 371 368 A 8 GLY HAy A 9 ALA H 1.0 1.8 5.5 372 369 A 8 GLY H A 9 ALA H 1.0 1.8 2.8 373 370 A 8 GLY H A 9 ALA H 1.0 1.8 2.8 374 371 A 9 ALA HA A 10 ALA H 1.0 1.8 5.5 375 372 A 9 ALA HA A 10 ALA H 1.0 1.8 5.5 376 373 A 9 ALA H A 10 ALA H 1.0 1.8 2.8 377 374 A 9 ALA H A 10 ALA H 1.0 1.8 2.8 378 375 A 10 ALA HB% A 11 LYS H 1.0 1.8 5.5 379 376 A 10 ALA H A 11 LYS H 1.0 1.8 2.8 380 377 A 10 ALA H A 11 LYS H 1.0 1.8 2.8 381 378 A 11 LYS HA A 12 ASP H 1.0 1.8 3.4 382 379 A 11 LYS HA A 12 ASP H 1.0 1.8 5.5 383 380 A 11 LYS HBx A 12 ASP H 1.0 1.8 3.4 384 381 A 11 LYS HBx A 12 ASP H 1.0 1.8 3.4 385 382 A 11 LYS H A 12 ASP H 1.0 1.8 2.8 386 383 A 11 LYS H A 12 ASP H 1.0 1.8 2.8 387 384 A 12 ASP HA A 13 ILE H 1.0 1.8 5.5 388 385 A 12 ASP HA A 13 ILE H 1.0 1.8 5.5 389 386 A 12 ASP HBx A 13 ILE H 1.0 1.8 5.5 390 387 A 12 ASP HBx A 13 ILE H 1.0 1.8 5.5 391 388 A 12 ASP HBy A 13 ILE H 1.0 1.8 5.5 392 389 A 12 ASP HBy A 13 ILE H 1.0 1.8 5.5 393 390 A 12 ASP H A 13 ILE H 1.0 1.8 3.4 394 391 A 12 ASP H A 13 ILE H 1.0 1.8 2.8 395 392 A 13 ILE HA A 14 ALA H 1.0 1.8 5.5 396 393 A 13 ILE HA A 14 ALA H 1.0 1.8 5.5 397 394 A 13 ILE HB A 14 ALA H 1.0 1.8 2.8 398 395 A 13 ILE HG1x A 14 ALA H 1.0 1.8 5.5 399 396 A 13 ILE HG1y A 14 ALA H 1.0 1.8 5.5 400 397 A 13 ILE HG2% A 14 ALA H 1.0 1.8 5.5 401 398 A 13 ILE HG2% A 14 ALA H 1.0 1.8 5.5 402 399 A 13 ILE H A 14 ALA H 1.0 1.8 2.8 403 400 A 13 ILE H A 14 ALA H 1.0 1.8 2.8 404 401 A 14 ALA HA A 15 GLY H 1.0 1.8 5.5 405 402 A 14 ALA HA A 15 GLY H 1.0 1.8 5.5 406 403 A 14 ALA H A 15 GLY H 1.0 1.8 3.4 407 404 A 14 ALA H A 15 GLY H 1.0 1.8 3.4 408 405 A 15 GLY H A 16 HIS HBy 1.0 1.8 5.5 409 406 A 15 GLY HAx A 16 HIS H 1.0 1.8 5.5 410 407 A 15 GLY HAx A 16 HIS H 1.0 1.8 5.5 411 408 A 15 GLY H A 16 HIS H 1.0 1.8 3.4 412 409 A 16 HIS HA A 17 LEU H 1.0 1.8 5.5 413 410 A 16 HIS HA A 17 LEU H 1.0 1.8 5.5 414 411 A 16 HIS HBy A 17 LEU H 1.0 1.8 3.4 415 412 A 16 HIS HBy A 17 LEU H 1.0 1.8 3.4 416 413 A 16 HIS HD2 A 17 LEU H 1.0 1.8 5.5 417 414 A 16 HIS HD2 A 17 LEU H 1.0 1.8 5.5 418 415 A 16 HIS H A 17 LEU H 1.0 1.8 3.4 419 416 A 16 HIS H A 17 LEU H 1.0 1.8 2.8 420 417 A 17 LEU HA A 18 ALA H 1.0 1.8 5.5 421 418 A 17 LEU HBx A 18 ALA H 1.0 1.8 5.5 422 419 A 17 LEU HBx A 18 ALA H 1.0 1.8 3.4 423 420 A 17 LEU HBy A 18 ALA H 1.0 1.8 5.5 424 421 A 17 LEU HBy A 18 ALA H 1.0 3.9 5.5 425 422 A 17 LEU H A 18 ALA H 1.0 1.8 2.8 426 423 A 17 LEU H A 18 ALA H 1.0 1.8 2.8 427 424 A 18 ALA HB% A 19 SER H 1.0 1.8 5.5 428 425 A 18 ALA HB% A 19 SER H 1.0 1.8 5.5 429 426 A 18 ALA H A 19 SER H 1.0 1.8 2.8 430 427 A 18 ALA H A 19 SER H 1.0 1.8 2.8 431 428 A 19 SER HA A 20 LYS HDy 1.0 1.8 5.5 432 429 A 19 SER HA A 20 LYS H 1.0 1.8 5.5 433 430 A 19 SER HA A 20 LYS H 1.0 1.8 5.5 434 431 A 19 SER H A 20 LYS H 1.0 1.8 3.4 435 432 A 19 SER H A 20 LYS H 1.0 1.8 3.4 436 433 A 20 LYS H A 21 VAL H 1.0 1.8 3.4 437 434 A 20 LYS H A 21 VAL H 1.0 1.8 2.8 438 435 A 21 VAL H A 22 MET H 1.0 1.8 2.8 439 436 A 21 VAL H A 22 MET H 1.0 1.8 2.8 440 437 A 22 MET HA A 23 ASN HBy 1.0 1.8 5.5 441 438 A 22 MET HGy A 23 ASN H 1.0 1.8 5.5 442 439 A 2 VAL HA A 4 ASP H 1.0 1.8 5.5 443 440 A 2 VAL HA A 4 ASP H 1.0 1.8 5.5 444 441 A 3 VAL HA A 5 ILE H 1.0 1.8 5.5 445 442 A 3 VAL H A 5 ILE H 1.0 1.8 5.5 446 443 A 3 VAL HA A 6 LEU HBx 1.0 1.8 3.4 447 444 A 3 VAL HA A 6 LEU HBx 1.0 1.8 3.4 448 445 A 3 VAL HA A 6 LEU HBy 1.0 1.8 5.5 449 446 A 3 VAL HA A 6 LEU HDx% 1.0 1.8 5.5 450 447 A 3 VAL HA A 6 LEU HDy% 1.0 1.8 5.5 451 448 A 3 VAL HA A 6 LEU H 1.0 1.8 5.5 452 449 A 3 VAL HA A 6 LEU H 1.0 1.8 5.5 453 450 A 4 ASP H A 6 LEU H 1.0 1.8 5.5 454 451 A 3 VAL HA A 7 LYS H 1.0 1.8 5.5 455 452 A 3 VAL HA A 7 LYS H 1.0 1.8 5.5 456 453 A 4 ASP HA A 7 LYS HBx 1.0 1.8 5.5 457 454 A 4 ASP HA A 7 LYS HBx 1.0 1.8 5.5 458 455 A 4 ASP HA A 7 LYS HBy 1.0 1.8 5.5 459 456 A 4 ASP HA A 7 LYS HBy 1.0 1.8 5.5 460 457 A 4 ASP HA A 7 LYS H 1.0 1.8 5.5 461 458 A 4 ASP HA A 7 LYS H 1.0 1.8 5.5 462 459 A 5 ILE H A 7 LYS H 1.0 1.8 5.5 463 460 A 5 ILE H A 7 LYS H 1.0 1.8 5.5 464 461 A 4 ASP HA A 8 GLY H 1.0 1.8 5.5 465 462 A 4 ASP HA A 8 GLY H 1.0 1.8 5.5 466 463 A 6 LEU HA A 8 GLY H 1.0 1.8 5.5 467 464 A 6 LEU HA A 8 GLY H 1.0 1.8 5.5 468 465 A 5 ILE HA A 9 ALA H 1.0 1.8 5.5 469 466 A 6 LEU HA A 9 ALA H 1.0 1.8 5.5 470 467 A 6 LEU HA A 9 ALA H 1.0 1.8 5.5 471 468 A 7 LYS HA A 9 ALA H 1.0 1.8 5.5 472 469 A 7 LYS HA A 9 ALA H 1.0 1.8 5.5 473 470 A 6 LEU HA A 10 ALA H 1.0 1.8 5.5 474 471 A 7 LYS HA A 10 ALA H 1.0 1.8 5.5 475 472 A 8 GLY H A 10 ALA H 1.0 1.8 5.5 476 473 A 8 GLY H A 10 ALA H 1.0 1.8 5.5 477 474 A 9 ALA HA A 11 LYS H 1.0 1.8 5.5 478 475 A 9 ALA HA A 11 LYS H 1.0 1.8 5.5 479 476 A 9 ALA H A 11 LYS H 1.0 1.8 5.5 480 477 A 9 ALA H A 11 LYS H 1.0 1.8 5.5 481 478 A 9 ALA HA A 12 ASP HBx 1.0 1.8 5.5 482 479 A 9 ALA HA A 12 ASP HBx 1.0 1.8 5.5 483 480 A 9 ALA HA A 12 ASP HBy 1.0 1.8 5.5 484 481 A 9 ALA HA A 12 ASP HBy 1.0 1.8 5.5 485 482 A 9 ALA HA A 12 ASP H 1.0 1.8 5.5 486 483 A 9 ALA HA A 12 ASP H 1.0 1.8 5.5 487 484 A 9 ALA HA A 13 ILE H 1.0 1.8 5.5 488 485 A 9 ALA HA A 13 ILE H 1.0 1.8 5.5 489 486 A 10 ALA HA A 13 ILE H 1.0 1.8 3.4 490 487 A 10 ALA HA A 13 ILE H 1.0 1.8 5.5 491 488 A 11 LYS H A 13 ILE H 1.0 1.8 5.5 492 489 A 11 LYS H A 13 ILE H 1.0 1.8 5.5 493 490 A 12 ASP HA A 14 ALA H 1.0 1.8 5.5 494 491 A 12 ASP HA A 14 ALA H 1.0 1.8 5.5 495 492 A 12 ASP HA A 15 GLY H 1.0 1.8 5.5 496 493 A 12 ASP HA A 15 GLY H 1.0 1.8 5.5 497 494 A 13 ILE HA A 15 GLY H 1.0 1.8 5.5 498 495 A 13 ILE HA A 15 GLY H 1.0 1.8 5.5 499 496 A 12 ASP HA A 16 HIS H 1.0 1.8 5.5 500 497 A 13 ILE HA A 16 HIS HBy 1.0 1.8 3.4 501 498 A 13 ILE HA A 16 HIS HBy 1.0 1.8 3.4 502 499 A 13 ILE HA A 16 HIS HD2 1.0 1.8 5.5 503 500 A 13 ILE HA A 16 HIS HD2 1.0 1.8 5.5 504 501 A 13 ILE HA A 16 HIS H 1.0 1.8 5.5 505 502 A 14 ALA HA A 16 HIS H 1.0 1.8 5.5 506 503 A 14 ALA HA A 16 HIS H 1.0 1.8 5.5 507 504 A 13 ILE HA A 17 LEU H 1.0 1.8 5.5 508 505 A 13 ILE HA A 17 LEU H 1.0 1.8 5.5 509 506 A 15 GLY HAx A 17 LEU H 1.0 1.8 5.5 510 507 A 15 GLY H A 17 LEU H 1.0 1.8 5.5 511 508 A 15 GLY H A 17 LEU H 1.0 1.8 5.5 512 509 A 14 ALA HA A 18 ALA H 1.0 1.8 5.5 513 510 A 15 GLY HAx A 18 ALA H 1.0 1.8 5.5 514 511 A 16 HIS HA A 18 ALA H 1.0 1.8 5.5 515 512 A 16 HIS HA A 18 ALA H 1.0 1.8 5.5 516 513 A 16 HIS H A 18 ALA H 1.0 1.8 5.5 517 514 A 15 GLY HAx A 19 SER H 1.0 1.8 5.5 518 515 A 16 HIS HA A 19 SER H 1.0 1.8 5.5 519 516 A 16 HIS HA A 19 SER H 1.0 1.8 5.5 520 517 A 17 LEU H A 19 SER H 1.0 1.8 5.5 521 518 A 16 HIS HBy A 20 LYS H 1.0 1.8 5.5 522 519 A 18 ALA HA A 20 LYS H 1.0 1.8 5.5 523 520 A 18 ALA HA A 20 LYS H 1.0 1.8 5.5 524 521 A 18 ALA HA A 21 VAL HB 1.0 1.8 5.5 525 522 A 18 ALA HA A 21 VAL HB 1.0 1.8 3.4 526 523 A 18 ALA HA A 21 VAL HGx% 1.0 1.8 5.5 527 524 A 18 ALA HA A 21 VAL H 1.0 1.8 5.5 528 525 A 18 ALA HA A 21 VAL H 1.0 1.8 5.5 529 526 A 19 SER HA A 21 VAL H 1.0 1.8 5.5 530 527 A 19 SER HA A 21 VAL H 1.0 1.8 5.5 531 528 A 19 SER H A 21 VAL H 1.0 1.8 5.5 532 529 A 18 ALA HA A 22 MET H 1.0 1.8 5.5 533 530 A 19 SER HA A 23 ASN HD2y 1.0 1.8 5.5 534 530 A 19 SER HA A 23 ASN HD2x 1.0 1.8 5.5 535 531 A 19 SER HA A 23 ASN HD2y 1.0 1.8 5.5 536 531 A 19 SER HA A 23 ASN HD2x 1.0 1.8 5.5 537 532 A 19 SER HBy A 23 ASN HD2y 1.0 1.8 5.5 538 532 A 19 SER HBy A 23 ASN HD2x 1.0 1.8 5.5 539 533 A 19 SER HA A 23 ASN HD2x 1.0 1.8 5.5 540 534 A 20 LYS HDy A 23 ASN H 1.0 1.8 5.5 541 535 A 20 LYS HDy A 23 ASN H 1.0 1.8 5.5 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 GLY C A 2 VAL N A 2 VAL CA A 2 VAL C 1.0 -71.83 -50.77 PHI 2 2 A 2 VAL C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -74.99 -54.43 PHI 3 3 A 3 VAL C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -69.09 -47.45 PHI 4 4 A 4 ASP C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -85.56 -48.50 PHI 5 5 A 5 ILE C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -75.10 -55.34 PHI 6 6 A 6 LEU C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -77.87 -52.75 PHI 7 7 A 7 LYS C A 8 GLY N A 8 GLY CA A 8 GLY C 1.0 -73.49 -50.85 PHI 8 8 A 8 GLY C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -75.32 -49.60 PHI 9 9 A 9 ALA C A 10 ALA N A 10 ALA CA A 10 ALA C 1.0 -71.02 -53.68 PHI 10 10 A 10 ALA C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -79.07 -50.71 PHI 11 11 A 11 LYS C A 12 ASP N A 12 ASP CA A 12 ASP C 1.0 -70.78 -55.84 PHI 12 12 A 12 ASP C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -90.43 -45.01 PHI 13 13 A 13 ILE C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -74.19 -58.67 PHI 14 14 A 14 ALA C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 -78.00 -52.36 PHI 15 15 A 15 GLY C A 16 HIS N A 16 HIS CA A 16 HIS C 1.0 -72.47 -49.83 PHI 16 16 A 16 HIS C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -77.62 -52.32 PHI 17 17 A 17 LEU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -74.02 -46.88 PHI 18 18 A 18 ALA C A 19 SER N A 19 SER CA A 19 SER C 1.0 -84.41 -47.75 PHI 19 19 A 19 SER C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -116.83 -46.89 PHI 20 20 A 20 LYS C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -77.65 -53.45 PHI 21 21 A 21 VAL C A 22 MET N A 22 MET CA A 22 MET C 1.0 -72.50 -55.36 PHI 22 22 A 2 VAL N A 2 VAL CA A 2 VAL C A 3 VAL N 1.0 -52.63 -30.07 PSI 23 23 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 ASP N 1.0 -56.57 -34.67 PSI 24 24 A 4 ASP N A 4 ASP CA A 4 ASP C A 5 ILE N 1.0 -50.01 -30.95 PSI 25 25 A 5 ILE N A 5 ILE CA A 5 ILE C A 6 LEU N 1.0 -55.60 -32.04 PSI 26 26 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 LYS N 1.0 -55.66 -18.16 PSI 27 27 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 GLY N 1.0 -60.61 -29.99 PSI 28 28 A 8 GLY N A 8 GLY CA A 8 GLY C A 9 ALA N 1.0 -58.87 -25.83 PSI 29 29 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 ALA N 1.0 -53.23 -31.87 PSI 30 30 A 10 ALA N A 10 ALA CA A 10 ALA C A 11 LYS N 1.0 -54.23 -30.43 PSI 31 31 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 ASP N 1.0 -57.50 -24.26 PSI 32 32 A 12 ASP N A 12 ASP CA A 12 ASP C A 13 ILE N 1.0 -54.28 -27.76 PSI 33 33 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 ALA N 1.0 -61.28 -21.64 PSI 34 34 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 GLY N 1.0 -45.26 -17.74 PSI 35 35 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 HIS N 1.0 -63.06 -19.42 PSI 36 36 A 16 HIS N A 16 HIS CA A 16 HIS C A 17 LEU N 1.0 -54.17 -26.61 PSI 37 37 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ALA N 1.0 -49.81 -36.75 PSI 38 38 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 SER N 1.0 -56.42 -27.76 PSI 39 39 A 19 SER N A 19 SER CA A 19 SER C A 20 LYS N 1.0 -58.25 1.91 PSI 40 40 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 VAL N 1.0 -64.67 0.75 PSI 41 41 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 MET N 1.0 -58.54 -27.00 PSI 42 42 A 22 MET N A 22 MET CA A 22 MET C A 23 ASN N 1.0 -52.55 -29.09 PSI stop_ save_